0 B12R0.1 C=CCC(=O)NCCCCCCO WXVL_AK0751SB2732 [0,1,0,0,0,0|1,0,1]=3 1 B12R0.1 C=CCC(=O)NCCCCCCO WXVL_AK0751SB2732 [0,1,0,0,0,0|1,0,1]=3 2 B12R0.47 C=CCCCC(=O)NCCCCC WXVL_AK0076SB2920 [0,1,0,0,0,0|2,0,1]=4 3 B12R0.47 C=CCCCC(=O)NCCCCC WXVL_AK0076SB2920 [0,1,0,0,0,0|2,0,1]=4 4 B12R0.47 C=CCCCC(=O)NCCCCO WXVL_AK0075SB2920 [0,1,0,0,0,0|1,0,1]=3 5 B12R0.47 C=CCCCC(=O)NCCCCO WXVL_AK0075SB2920 [0,1,0,0,0,0|1,0,1]=3 6 B12R0.47 C=CCCNC(=O)CCCCCBr WXVL_AK00138SB2192 [0,1,0,0,0,0|2,0,1]=4 7 B12R0.47 C=CCCNC(=O)CCCCCBr WXVL_AK00138SB2192 [0,1,0,0,0,0|2,0,1]=4 8 B12R0.47 C=CCCNC(=O)CCCCCO WXVL_AK00138SB2973 [0,1,0,0,0,0|1,0,1]=3 9 B12R0.47 C=CCCNC(=O)CCCCCO WXVL_AK00138SB2973 [0,1,0,0,0,0|1,0,1]=3 10 B12R0.206 C=CCCC(=O)NCCCCCC WXVL_AK0286SB1035 [0,1,0,0,0,0|2,0,1]=4 11 B12R0.206 C=CCCC(=O)NCCCCCC WXVL_AK0286SB1035 [0,1,0,0,0,0|2,0,1]=4 12 B12R0.206 C=CCCC(=O)NCCCCCO WXVL_AK0077SB1035 [0,1,0,0,0,0|1,0,1]=3 13 B12R0.206 C=CCCC(=O)NCCCCCO WXVL_AK0077SB1035 [0,1,0,0,0,0|1,0,1]=3 14 B12R0.206 C=CCCC(=O)NCCNCCO WXVL_AK0954SB1035 [0,1,0,0,0,0|2,0,1]=4 15 B12R0.206 C=CCCC(=O)NCCNCCO WXVL_AK0954SB1035 [0,1,0,0,0,0|2,0,1]=4 16 B12R0.206 C=CCNC(=O)CCCCCCBr WXVL_AK00561SB1386 [0,1,0,0,0,0|2,0,1]=4 17 B12R0.206 C=CCNC(=O)CCCCCCBr WXVL_AK00561SB1386 [0,1,0,0,0,0|2,0,1]=4 18 B12R0.206 C=CCNC(=O)CCCCCCC WXVL_AK00561SB0393 [0,1,0,0,0,0|2,0,1]=4 19 B12R0.206 C=CCNC(=O)CCCCCCC WXVL_AK00561SB0393 [0,1,0,0,0,0|2,0,1]=4 20 B12R0.234 C=CCCCCCCCCC(=O)N WXVL_AK0084SB0481 [0,1,0,0,0,0|0,0,2]=3 21 B12R0.234 C=CCCCCCCCCC(=O)N WXVL_AK0084SB0481 [0,1,0,0,0,0|0,0,2]=3 22 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [0,1,0,0,0,0|1,0,1]=3 23 B12R0.234 CC(=O)NCCCCCCCCO WXVL_AK4142SB0150 [0,1,0,0,0,0|1,0,1]=3 24 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [0,1,0,0,0,0|2,0,0]=3 25 B12R0.234 CCCCCCCCCCC(=O)N WXVL_AK0084SB0490 [0,1,0,0,0,0|2,0,0]=3 26 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [0,1,0,0,0,0|2,0,1]=4 27 B12R0.234 CCCCCCCCCNC(=O)C WXVL_AK1826SB0150 [0,1,0,0,0,0|2,0,1]=4 28 B11R0.4 C=CCC(=O)NCCCCCC WXVL_AK0286SB2732 [1,1,0,0,0,0|1,0,1]=4 29 B11R0.4 C=CCC(=O)NCCCCCC WXVL_AK0286SB2732 [1,1,0,0,0,0|1,0,1]=4 30 B11R0.4 C=CCC(=O)NCCCCCO WXVL_AK0077SB2732 [1,1,0,0,0,0|1,0,1]=4 31 B11R0.4 C=CCC(=O)NCCCCCO WXVL_AK0077SB2732 [1,1,0,0,0,0|1,0,1]=4 32 B11R0.81 C=CCCC(=O)NCCCCC WXVL_AK0076SB1035 [1,1,0,0,0,0|1,0,1]=4 33 B11R0.81 C=CCCC(=O)NCCCCC WXVL_AK0076SB1035 [1,1,0,0,0,0|1,0,1]=4 34 B11R0.81 C=CCCC(=O)NCCCCO WXVL_AK0075SB1035 [1,1,0,0,0,0|1,0,1]=4 35 B11R0.81 C=CCCC(=O)NCCCCO WXVL_AK0075SB1035 [1,1,0,0,0,0|1,0,1]=4 36 B11R0.81 C=CCNC(=O)CCCCCO WXVL_AK00561SB2973 [1,1,0,0,0,0|1,0,1]=4 37 B11R0.81 C=CCNC(=O)CCCCCO WXVL_AK00561SB2973 [1,1,0,0,0,0|1,0,1]=4 38 B11R0.140 C=CCCCC(=O)NCCCC WXVL_AK00588SB2920 [1,1,0,0,0,0|1,0,1]=4 39 B11R0.140 C=CCCCC(=O)NCCCC WXVL_AK00588SB2920 [1,1,0,0,0,0|1,0,1]=4 40 B11R0.140 C=CCCCC(=O)NCCCO WXVL_AK0073SB2920 [1,1,0,0,0,0|1,0,1]=4 41 B11R0.140 C=CCCCC(=O)NCCCO WXVL_AK0073SB2920 [1,1,0,0,0,0|1,0,1]=4 42 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,1,0,0,0,0|1,0,0]=3 43 B11R0.148 CCCCCCCCCC(=O)N WXVL_AK0084SB0447 [1,1,0,0,0,0|1,0,0]=3 44 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,1,0,0,0,0|1,0,1]=4 45 B11R0.148 CCCCCCCCNC(=O)C WXVL_AK1818SB0150 [1,1,0,0,0,0|1,0,1]=4 46 B13R0.2 C=CCC(=O)NCCCCCCCC WXVL_AK1818SB2732 [0,2,0,0,0,0|1,0,1]=4 47 B13R0.2 C=CCC(=O)NCCCCCCCC WXVL_AK1818SB2732 [0,2,0,0,0,0|1,0,1]=4 48 B13R0.66 C=CCCC(=O)NCCCCCCO WXVL_AK0751SB1035 [0,2,0,0,0,0|0,0,1]=3 49 B13R0.66 C=CCCC(=O)NCCCCCCO WXVL_AK0751SB1035 [0,2,0,0,0,0|0,0,1]=3 50 B13R0.66 C=CCNC(=O)CCCCCCCBr WXVL_AK00561SB0559 [0,2,0,0,0,0|1,0,1]=4 51 B13R0.66 C=CCNC(=O)CCCCCCCBr WXVL_AK00561SB0559 [0,2,0,0,0,0|1,0,1]=4 52 B13R0.66 C=CCNC(=O)CCCCCCCC WXVL_AK00561SB0409 [0,2,0,0,0,0|1,0,1]=4 53 B13R0.66 C=CCNC(=O)CCCCCCCC WXVL_AK00561SB0409 [0,2,0,0,0,0|1,0,1]=4 54 B13R0.66 C=CCNC(=O)CCCCCCCO WXVL_AK00561SB1306 [0,2,0,0,0,0|0,0,1]=3 55 B13R0.66 C=CCNC(=O)CCCCCCCO WXVL_AK00561SB1306 [0,2,0,0,0,0|0,0,1]=3 56 B13R0.1338 C=CCS(=O)(=O)NCCCCCCO WXVL_AK0751HU0152 [0,2,0,0,0,0|2,0,0]=4 57 B13R0.1338 C=CCS(=O)(=O)NCCCCCCO WXVL_AK0751HU0152 [0,2,0,0,0,0|2,0,0]=4 58 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,2,0,0,0,0|1,0,1]=4 59 B13R0.54 CCCCCCCCCCCC(=O)N WXVL_AK0084SB2796 [0,2,0,0,0,0|1,0,1]=4 60 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,2,0,0,0,0|1,0,1]=4 61 B13R0.54 CCCCCCCCCCNC(=O)C WXVL_AK1845SB0150 [0,2,0,0,0,0|1,0,1]=4 62 B13R0.147 C#CC(=O)NCCCCCCCCO WXVL_AK4142SB0338 [0,2,0,0,0,0|1,0,1]=4 63 B13R0.147 C#CC(=O)NCCCCCCCCO WXVL_AK4142SB0338 [0,2,0,0,0,0|1,0,1]=4 64 B13R0.147 C=CCCCCCCCCC(=O)NC WXVL_AK00442SB0481 [0,2,0,0,0,0|0,0,2]=4 65 B13R0.147 C=CCCCCCCCCC(=O)NC WXVL_AK00442SB0481 [0,2,0,0,0,0|0,0,2]=4 66 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|1,0,1]=4 67 B13R0.147 CCC(=O)NCCCCCCCCO WXVL_AK4142SB0064 [0,2,0,0,0,0|1,0,1]=4 68 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [0,2,0,0,0,0|1,0,1]=4 69 B13R0.147 CCCCCCCCCCC(=O)NC WXVL_AK00442SB0490 [0,2,0,0,0,0|1,0,1]=4 70 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,1]=4 71 B13R0.147 O=C(CO)NCCCCCCCCO WXVL_AK4142SB2706 [0,2,0,0,0,0|1,0,1]=4 72 B13R0.338 C=CCCCC(=O)NCCCCCC WXVL_AK0286SB2920 [0,2,0,0,0,0|1,0,1]=4 73 B13R0.338 C=CCCCC(=O)NCCCCCC WXVL_AK0286SB2920 [0,2,0,0,0,0|1,0,1]=4 74 B13R0.338 C=CCCCC(=O)NCCCCCO WXVL_AK0077SB2920 [0,2,0,0,0,0|0,0,1]=3 75 B13R0.338 C=CCCCC(=O)NCCCCCO WXVL_AK0077SB2920 [0,2,0,0,0,0|0,0,1]=3 76 B13R0.338 C=CCCCC(=O)NCCNCCO WXVL_AK0954SB2920 [0,2,0,0,0,0|1,0,1]=4 77 B13R0.338 C=CCCCC(=O)NCCNCCO WXVL_AK0954SB2920 [0,2,0,0,0,0|1,0,1]=4 78 B13R0.338 C=CCCNC(=O)CCCCCCBr WXVL_AK00138SB1386 [0,2,0,0,0,0|1,0,1]=4 79 B13R0.338 C=CCCNC(=O)CCCCCCBr WXVL_AK00138SB1386 [0,2,0,0,0,0|1,0,1]=4 80 B13R0.338 C=CCCNC(=O)CCCCCCC WXVL_AK00138SB0393 [0,2,0,0,0,0|1,0,1]=4 81 B13R0.338 C=CCCNC(=O)CCCCCCC WXVL_AK00138SB0393 [0,2,0,0,0,0|1,0,1]=4 82 B13R0.194 C=CCCCC(=O)NCCC(C)CO WXVL_AK4143SB2920 [0,2,0,0,0,0|1,0,1]=4 83 B13R0.194 C=CCCCC(=O)NCCC(C)CO WXVL_AK4143SB2920 [0,2,0,0,0,0|1,0,1]=4 84 B13R1.42 C=CCC(=O)NCC1CCCCO1 WXVL_AK1232SB2732 [0,1,0,1,0,0|1,0,1]=4 85 B13R1.42 C=CCC(=O)NCC1CCCCO1 WXVL_AK1232SB2732 [0,1,0,1,0,0|1,0,1]=4 86 B13R1.464 C=CCC(=O)N1CCCCC1CO WXVL_AN0018SB2732 [0,1,0,1,0,0|1,0,1]=4 87 B13R1.464 C=CCC(=O)N1CCCCC1CO WXVL_AN0018SB2732 [0,1,0,1,0,0|1,0,1]=4 88 B13R1.24 C=CCCNC(=O)C1CCCCO1 WXVL_AK00138SB0206 [0,1,0,1,0,0|1,0,1]=4 89 B13R1.24 C=CCCNC(=O)C1CCCCO1 WXVL_AK00138SB0206 [0,1,0,1,0,0|1,0,1]=4 90 B13R1.24 C=CCCNC(=O)[C@H]1CCCCO1 WXVL_AK00138SB00044 [0,1,0,1,0,0|1,0,1]=4 91 B13R1.24 C=CCCNC(=O)[C@H]1CCCCO1 WXVL_AK00138SB00044 [0,1,0,1,0,0|1,0,1]=4 92 B13R1.726 C=CCCCC(=O)N1CC[C@@H]1CO WXVL_AN00694SB2920 [0,1,0,1,0,0|1,0,1]=4 93 B13R1.726 C=CCCCC(=O)N1CC[C@H]1CO WXVL_AN3414SB2920 [0,1,0,1,0,0|1,0,1]=4 94 B13R1.726 C=CCCCC(=O)N1CC[C@H]1CO WXVL_AN3414SB2920 [0,1,0,1,0,0|1,0,1]=4 95 B13R1.728 C=CCCCC(=O)NCC1CCO1 WXVL_AK1433SB2920 [0,1,0,1,0,0|1,0,1]=4 96 B13R1.728 C=CCCCC(=O)NCC1CCO1 WXVL_AK1433SB2920 [0,1,0,1,0,0|1,0,1]=4 97 B13R1.44 C=CCNC(=O)CC1CCCCO1 WXVL_AK00561SB1464 [0,1,0,1,0,0|1,0,1]=4 98 B13R1.44 C=CCNC(=O)CC1CCCCO1 WXVL_AK00561SB1464 [0,1,0,1,0,0|1,0,1]=4 99 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 WXVL_AK00754SB1035 [0,1,0,1,0,0|1,0,1]=4 100 B13R1.153 C=CCCC(=O)NC[C@@H]1CCCO1 WXVL_AK00754SB1035 [0,1,0,1,0,0|1,0,1]=4 101 B13R1.684 C=CCCC(=O)N1CCC[C@H]1CO WXVL_AN0917SB1035 [0,1,0,1,0,0|1,0,1]=4